Geometry & MOs

Info

ID:	368108
PubChem CID:	127327485
Reduced:	BrON5C13H16 (1)
Stoich.:	ABC5D13E16 (1)
Weight, g/mol:	340.109293
ΔH_f, kcal/mol:	40.77
Dipole, Da:	8.38
IP(EA), eV:	-8.75(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-(4-morpholin-4-ylsulfonylphenoxy)pyrrolidin-2-one

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2CCN(C2)C3=C(C(=O)N(N=C3)C)Br

DOS

IR

Vibrations